SCHEMBL6085356

SCHEMBL6085356

CC(C)NC(=O)Nc1ccc(-c2n[nH]cc2-c2nc3cc(C(C)(C)C)ccc3o2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.44
CETP P11597 3/20 0.43
MAPT P10636 3/20 0.42
TP53 P04637 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CASP3 P42574 2/20 0.41
SENP7 Q9BQF6 1/20 0.41
AGPAT2 O15120 2/20 0.41
NPC1 O15118 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 2/20 0.40
UTRN P46939 1/20 0.40
KDM4E B2RXH2 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6085115 0.90 CETP (0.47) RXFP1CETPMAPTTP53HDAC3
SCHEMBL6086007 0.90 AGPAT2 (0.48) RXFP1CETPMAPTTP53HDAC3
SCHEMBL6085453 0.89 MAPT (0.49) RXFP1CETPMAPTTP53HDAC3
SCHEMBL6086097 0.88 NPC1 (0.52) RXFP1CETPMAPTTP53HDAC3
SCHEMBL6086312 0.88 MAPT (0.52) RXFP1CETPMAPTTP53NPC1
SCHEMBL6085392 0.88 CETP (0.45) RXFP1CETPMAPTTP53HDAC3
SCHEMBL6085063 0.86 NPC1 (0.52) RXFP1MAPTTP53AGPAT2NPC1
SCHEMBL6084919 0.86 MAPT (0.56) RXFP1MAPTTP53HDAC3HDAC1
SCHEMBL6084937 0.85 CETP (0.49) RXFP1CETPMAPTTP53NPC1
SCHEMBL6086251 0.85 RAB9A (0.52) RXFP1CETPMAPTTP53AGPAT2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 US claimed
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US disclosed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP disclosed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors MAP3K15, MAP3K20, MAP3K3 RXFP1 4580/4885CETP 4875/4885MAPT 801/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.